Kekulé Structures in Benzenoid Hydrocarbons

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Publisher : Springer Science & Business Media
ISBN 13 : 3662008920
Total Pages : 366 pages
Book Rating : 4.6/5 (62 download)

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Book Synopsis Kekulé Structures in Benzenoid Hydrocarbons by : Sven J. Cyvin

Download or read book Kekulé Structures in Benzenoid Hydrocarbons written by Sven J. Cyvin and published by Springer Science & Business Media. This book was released on 2013-04-17 with total page 366 pages. Available in PDF, EPUB and Kindle. Book excerpt: This text is an attempt to outline the basic facts concerning Kekul€ structures in benzenoid hydrocarbons: their history, applica tions and especially enumeration. We further pOint out the numerous and often quite remarkable connections between this topic and various parts of combinatorics and discrete mathematics. Our book is primarily aimed toward organic and theoretical chemists interested in the enume ration of Kekule structures of conjugated hydrocarbons as well as to scientists working in the field of mathematical and computational chemistry. The book may be of some relevance also to mathematicians wishing to learn about contemporary applications of combinatorics, graph theory and other branches of discrete mathematics. In 1985, when we decided to prepare these notes for publication, we expected to be able to give a complete account of all known combi natorial formulas for the number of Kekule structures of benzenoid hydrocarbons. This turned out to be a much more difficult task than we initially realized: only in 1986 some 60 new publications appeared dealing with the enumeration of Kekule structures in benzenoids and closely related topics. In any event, we believe that we have collec ted and systematized the essential part of the presently existing results. In addition to this we were delighted to see that the topics to·which we have been devoted in the last few years nowadays form a rapidly expanding branch of mathematical chemistry which attracts the attention of a large number of researchers (both chemists and mathematicians).

Kekulé Structures in Benzenoid Hydrocarbons

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Publisher : Springer
ISBN 13 :
Total Pages : 374 pages
Book Rating : 4.:/5 (44 download)

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Book Synopsis Kekulé Structures in Benzenoid Hydrocarbons by : Sven J. Cyvin

Download or read book Kekulé Structures in Benzenoid Hydrocarbons written by Sven J. Cyvin and published by Springer. This book was released on 1988-02-10 with total page 374 pages. Available in PDF, EPUB and Kindle. Book excerpt: This text is an attempt to outline the basic facts concerning Kekule structures in benzenoid hydrocarbons: their history, applica­ tions and especially enumeration. We further pOint out the numerous and often quite remarkable connections between this topic and various parts of combinatorics and discrete mathematics. Our book is primarily aimed toward organic and theoretical chemists interested in the enume­ ration of Kekule structures of conjugated hydrocarbons as well as to scientists working in the field of mathematical and computational chemistry. The book may be of some relevance also to mathematicians wishing to learn about contemporary applications of combinatorics, graph theory and other branches of discrete mathematics. In 1985, when we decided to prepare these notes for publication, we expected to be able to give a complete account of all known combi­ natorial formulas for the number of Kekule structures of benzenoid hydrocarbons. This turned out to be a much more difficult task than we initially realized: only in 1986 some 60 new publications appeared dealing with the enumeration of Kekule structures in benzenoids and closely related topics. In any event, we believe that we have collec­ ted and systematized the essential part of the presently existing results. In addition to this we were delighted to see that the topics to·which we have been devoted in the last few years nowadays form a rapidly expanding branch of mathematical chemistry which attracts the attention of a large number of researchers (both chemists and mathematicians).

Introduction to the Theory of Benzenoid Hydrocarbons

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Publisher : Springer Science & Business Media
ISBN 13 : 3642871437
Total Pages : 157 pages
Book Rating : 4.6/5 (428 download)

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Book Synopsis Introduction to the Theory of Benzenoid Hydrocarbons by : Ivan Gutman

Download or read book Introduction to the Theory of Benzenoid Hydrocarbons written by Ivan Gutman and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 157 pages. Available in PDF, EPUB and Kindle. Book excerpt: In the last hundred years benzenoid hydrocarbons have constantly attracted the attention of both experimental and theoretical chemists. In spite of the fact that some of the basic concepts of the theory of benzenoid hydrocarbons have their origins in the 19th and early 20th century, research in this area is still in vigorous expansion. The present book provides an outline of the most important current theoretical approaches to benzenoids. Emphasis is laid on the recent developments of these theories, which can certainly be characterized as a significant advance. Em phasis is also laid on practical applications rather than on "pure" theory. The book assumes only some elementary knowledge of organic and physical chemistry and requires no special mathematical training. Therefore we hope that undergraduate students of chemistry will be able to follow the text without any difficulty. Since organic and physical chemists are nowadays not properly acquaint ed lVith the modern theory of benzenoid molecules, we hope that they will find this book both useful and informative. Our book is also aimed at theoretical chemists, especially those concerned with the "topological" features of organic molecules. The authors are indebted to Dr. WERNER SCHMIDT (Ahrensburg, FRG) for valuable discussions. One of the authors (1. G.) thanks the Royal Norwegian Council for Scientific and Industrial Research for financial support during 1988, which enabled him to stay at the University of Trondheim and write the present book. Trondheim, July 1989 Ivan Gutman Sven J. Cyvin Contents Chapter 1 Benzenoid Hydrocarbons .

Theory of Coronoid Hydrocarbons II

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Publisher : Springer Science & Business Media
ISBN 13 : 3642501575
Total Pages : 305 pages
Book Rating : 4.6/5 (425 download)

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Book Synopsis Theory of Coronoid Hydrocarbons II by : S.J. Cyvin

Download or read book Theory of Coronoid Hydrocarbons II written by S.J. Cyvin and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 305 pages. Available in PDF, EPUB and Kindle. Book excerpt: The present monograph is a continuation of Cyvin SJ, Brunvoll J and Cyvin (1991c), a reference to be found in Bibliography. Naturally, the previous volume is cited frequently here. For the sake of brevity, it is referred to as "Volume I". References to different chapters, sections or paragraphs are given like Vol. 1-1, 1-1.2 or 1-1.2.2, respectively. Also tables and equations in "Volume I" are cited; the very last equation therein, for instance, is Vol. I-{9.9). The present text spans from references to organic syntheses or attempted organic syntheses - - to stringent mathematical theorems proved by graph-theoretical methods. Enumerations of coronoid systems is a substantial part of the work. Algebraic methods involving combinatorics and generating functions are employed on one hand, and computer programming on the other. The whole book is supposed to demonstrate a piece of mathematical chemistry, which can be characterized as lying on the "interfaces between mathematics, chemistry and computer science", a formulation used for the MATH/CHEM/COMP Conferences; d. Cyvin SJ, Brunvoll and Cyvin (1989d) in Bibliography. Financial support to BNC from the Norwegian Council for Science and the Humanities is gratefully acknowledged.

Symmetry 2

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Publisher : Elsevier
ISBN 13 : 148329949X
Total Pages : 1091 pages
Book Rating : 4.4/5 (832 download)

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Book Synopsis Symmetry 2 by : I. Hargittai

Download or read book Symmetry 2 written by I. Hargittai and published by Elsevier. This book was released on 2016-02-25 with total page 1091 pages. Available in PDF, EPUB and Kindle. Book excerpt: Symmetry 2 aims to present an overview of the contemporary status of symmetry studies, particularly in the arts and sciences, emphasizing both its role and importance. Symmetry is not only one of the fundamental concepts in science, but is also possibly the best unifying concept between various branches of science, the arts and other human activities. Whereas symmetry has been considered important for centuries primarily for its aesthetic appeal, this century has witnessed a dramatic enhancement of its status as a cornerstone in the sciences. In addition to traditionally symmetry-oriented fields such as crystallography and spectroscopy, the concept has made headway in fields as varied as reaction chemistry, nuclear physics, and the study of the origin of the universe. The book was initiated in response to the success of the first volume, which not only received good reviews, but received the award for "The Best Single Issue of a Journal" by the Association of American Publishers for 1986. The second volume extends the application of symmetry to new fields, such as medical sciences and economics, as well as investigating further certain topics introduced in Symmetry. The book is extensively illustrated and with over 64 contributions from 16 countries presents an international overview of the nature and diversity of symmetry studies today.

New Frontiers in Nanochemistry: Concepts, Theories, and Trends

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Publisher : CRC Press
ISBN 13 : 0429663153
Total Pages : 401 pages
Book Rating : 4.4/5 (296 download)

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Book Synopsis New Frontiers in Nanochemistry: Concepts, Theories, and Trends by : Mihai V. Putz

Download or read book New Frontiers in Nanochemistry: Concepts, Theories, and Trends written by Mihai V. Putz and published by CRC Press. This book was released on 2020-05-06 with total page 401 pages. Available in PDF, EPUB and Kindle. Book excerpt: New Frontiers in Nanochemistry: Concepts, Theories, and Trends, Volume 2: Topological Nanochemistry is the second of the new three-volume set that explains and explores the important basic and advanced modern concepts in multidisciplinary chemistry. Under the broad expertise of the editor, this second volume explores the rich research areas of nanochemistry with a specific focus on the design and control of nanotechnology by structural and reactive topology. The objective of this particular volume is to emphasize the application of nanochemistry. With 46 entries from eminent international scientists and scholars, the content in this volume spans concepts from A-to-Z—from entries on the atom-bond connectivity index to the Zagreb indices, from connectivity to vapor phase epitaxy, and from fullerenes to topological reactivity—and much more. The definitions within the text are accompanied by brief but comprehensive explicative essays as well as figures, tables, etc., providing a holistic understanding of the concepts presented.

Carbon Bonding and Structures

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Publisher : Springer Science & Business Media
ISBN 13 : 9400717334
Total Pages : 445 pages
Book Rating : 4.4/5 (7 download)

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Book Synopsis Carbon Bonding and Structures by : Mihai V. Putz

Download or read book Carbon Bonding and Structures written by Mihai V. Putz and published by Springer Science & Business Media. This book was released on 2011-08-27 with total page 445 pages. Available in PDF, EPUB and Kindle. Book excerpt: "Carbon Bonding and Structures: Advances in Physics and Chemistry" features detailed reviews which describe the latest advances in the modeling and characterization of fundamental carbon based materials and recently designed carbon composites. Significant advances are reported and reviewed by globally recognized experts in the field. The quantification, indexing, and interpretation of physical and chemical patterns of carbon atoms in molecules, crystals, and nanosystems is presented. "Carbon Bonding and Structures: Advances in Physics and Chemistry" will be primarily of interest to theoretical physical chemists and computational materials scientists based in academia, government laboratories, and industry.

Theory of Coronoid Hydrocarbons

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Publisher : Springer Science & Business Media
ISBN 13 : 3642511104
Total Pages : 179 pages
Book Rating : 4.6/5 (425 download)

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Book Synopsis Theory of Coronoid Hydrocarbons by : Sven J. Cyvin

Download or read book Theory of Coronoid Hydrocarbons written by Sven J. Cyvin and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 179 pages. Available in PDF, EPUB and Kindle. Book excerpt: The mathematical treatment of coronoid hydrocarbons is a continuation of the authors' previous book Kekulé Structures in Benzenoid Hydrocarbons (Lecture Notes in Chemistry, Vol. 46). The book addresses theoretical and mathematical chemists and graduate students. The treatment includes topological properties of coronoid systems, their enumeration and classification, the number of Kekulé structures and of aromatic sextets.

Symmetry

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Publisher : Elsevier
ISBN 13 : 1483149528
Total Pages : 1068 pages
Book Rating : 4.4/5 (831 download)

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Book Synopsis Symmetry by : István Hargittai

Download or read book Symmetry written by István Hargittai and published by Elsevier. This book was released on 2014-05-23 with total page 1068 pages. Available in PDF, EPUB and Kindle. Book excerpt: International Series in Modern Applied Mathematics and Computer Science, Volume 10: Symmetry: Unifying Human Understanding provides a tremendous scope of "symmetry, covering subjects from fractals through court dances to crystallography and literature. This book discusses the limits of perfection, symmetry as an aesthetic factor, extension of the Neumann-Minnigerode-Curie principle, and symmetry of point imperfections in solids. The symmetry rules for chemical reactions, matching and symmetry of graphs, mosaic patterns of H. J. Woods, and bilateral symmetry in insects are also elaborated. This text likewise covers the crystallographic patterns, Milton's mathematical symbol of theodicy, symmetries of soap films, and gapon formalism. This volume is a good source for researchers and specialists concerned with symmetry.

Chemical Graph Theory

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Publisher : Routledge
ISBN 13 : 1351461567
Total Pages : 268 pages
Book Rating : 4.3/5 (514 download)

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Book Synopsis Chemical Graph Theory by : Nenad Trinajstic

Download or read book Chemical Graph Theory written by Nenad Trinajstic and published by Routledge. This book was released on 2018-05-11 with total page 268 pages. Available in PDF, EPUB and Kindle. Book excerpt: New Edition! Completely Revised and Updated Chemical Graph Theory, 2nd Edition is a completely revised and updated edition of a highly regarded book that has been widely used since its publication in 1983. This unique book offers a basic introduction to the handling of molecular graphs - mathematical diagrams representing molecular structures. Using mathematics well within the vocabulary of most chemists, this volume elucidates the structural aspects of chemical graph theory: (1) the relationship between chemical and graph-theoretical terminology, elements of graph theory, and graph-theoretical matrices; (2) the topological aspects of the Hückel theory, resonance theory, and theories of aromaticity; and (3) the applications of chemical graph theory to structure-property and structure-activity relationships and to isomer enumeration. An extensive bibliography covering the most relevant advances in theory and applications is one of the book's most valuable features. This volume is intended to introduce the entire chemistry community to the applications of graph theory and will be of particular interest to theoretical organic and inorganic chemists, physical scientists, computational chemists, and those already involved in mathematical chemistry.

New Frontiers in Nanochemistry: Concepts, Theories, and Trends, 3-Volume Set

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Publisher : CRC Press
ISBN 13 : 0429634099
Total Pages : 1479 pages
Book Rating : 4.4/5 (296 download)

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Book Synopsis New Frontiers in Nanochemistry: Concepts, Theories, and Trends, 3-Volume Set by : Mihai V. Putz

Download or read book New Frontiers in Nanochemistry: Concepts, Theories, and Trends, 3-Volume Set written by Mihai V. Putz and published by CRC Press. This book was released on 2022-05-30 with total page 1479 pages. Available in PDF, EPUB and Kindle. Book excerpt: New Frontiers in Nanochemistry: Concepts, Theories, and Trends, 3-Volume Set explains and explores the important fundamental and advanced modern concepts from various areas of nanochemistry and, more broadly, the nanosciences. This innovative and one-of-a kind set consists of three volumes that focus on structural nanochemistry, topological nanochemistry, and sustainable nanochemistry respectively, collectively forming an explicative handbook in nanochemistry. The compilation provides a rich resource that is both thorough and accessible, encompassing the core concepts of multiple areas of nanochemistry. It also explores the content through a trans-disciplinary lens, integrating the basic and advanced modern concepts in nanochemistry with various examples, applications, issues, tools, algorithms, and even historical notes on the important people from physical, quantum, theoretical, mathematical, and even biological chemistry.

Applications of Topological Methods in Molecular Chemistry

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Publisher : Springer
ISBN 13 : 3319290223
Total Pages : 582 pages
Book Rating : 4.3/5 (192 download)

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Book Synopsis Applications of Topological Methods in Molecular Chemistry by : Remi Chauvin

Download or read book Applications of Topological Methods in Molecular Chemistry written by Remi Chauvin and published by Springer. This book was released on 2016-04-19 with total page 582 pages. Available in PDF, EPUB and Kindle. Book excerpt: This is the first edited volume that features two important frameworks, Hückel and quantum chemical topological analyses. The contributors, which include an array of academics of international distinction, describe recent applications of such topological methods to various fields and topics that provide the reader with the current state-of-the-art and give a flavour of the wide range of their potentialities.

Chemical Modelling

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Publisher : Royal Society of Chemistry
ISBN 13 : 1847553338
Total Pages : 441 pages
Book Rating : 4.8/5 (475 download)

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Book Synopsis Chemical Modelling by : Alan Hinchliffe

Download or read book Chemical Modelling written by Alan Hinchliffe and published by Royal Society of Chemistry. This book was released on 2007-10-31 with total page 441 pages. Available in PDF, EPUB and Kindle. Book excerpt: Chemical Modelling: Applications and Theory comprises critical literature reviews of molecular modelling, both theoretical and applied. Molecular modelling in this context refers to modelling the structure, properties and reactions of atoms, molecules & materials. Each chapter is compiled by experts in their fields and provides a selective review of recent literature, incorporating sufficient historical perspective for the non-specialist to gain an understanding. With chemical modelling covering such a wide range of subjects, this Specialist Periodical Report serves as the first port of call to any chemist, biochemist, materials scientist or molecular physicist needing to acquaint themselves with major developments in the area.

Valence Bond Theory

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Publisher : Elsevier
ISBN 13 : 0080543499
Total Pages : 837 pages
Book Rating : 4.0/5 (85 download)

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Book Synopsis Valence Bond Theory by : David Cooper

Download or read book Valence Bond Theory written by David Cooper and published by Elsevier. This book was released on 2002-06-05 with total page 837 pages. Available in PDF, EPUB and Kindle. Book excerpt: Valence bond (VB) theory, which builds the descriptions of molecules from those of its constituent parts, provided the first successful quantum mechanical treatments of chemical bonding. Its language and concepts permeate much of chemistry, at all levels. Various modern formulations of VB theory represent serious tools for quantum chemical studies of molecular electronic structure and reactivity. In physics, there is much VB-based work (particularly in semi-empirical form) on larger systems. Importance of TopicThe last decade has seen significant advances in methodology and a vast increase in the range of applications, with many new researchers entering the field.Why This TitleValence Bond Theory succeeds in presenting a comprehensive selection of contributions from leading valence bond (VB) theory researchers throughout the world. It focuses on the vast increase in the range of applications of methodology based on VB theory during the last decade and especially emphasizes recent advances.

Quo Vadis, Graph Theory?

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Publisher : Elsevier
ISBN 13 : 0080867952
Total Pages : 407 pages
Book Rating : 4.0/5 (88 download)

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Book Synopsis Quo Vadis, Graph Theory? by : J. Gimbel

Download or read book Quo Vadis, Graph Theory? written by J. Gimbel and published by Elsevier. This book was released on 1993-03-17 with total page 407 pages. Available in PDF, EPUB and Kindle. Book excerpt: Graph Theory (as a recognized discipline) is a relative newcomer to Mathematics. The first formal paper is found in the work of Leonhard Euler in 1736. In recent years the subject has grown so rapidly that in today's literature, graph theory papers abound with new mathematical developments and significant applications.As with any academic field, it is good to step back occasionally and ask Where is all this activity taking us?, What are the outstanding fundamental problems?, What are the next important steps to take?. In short, Quo Vadis, Graph Theory?. The contributors to this volume have together provided a comprehensive reference source for future directions and open questions in the field.

Partial Order in Environmental Sciences and Chemistry

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Publisher : Springer Science & Business Media
ISBN 13 : 3540339701
Total Pages : 404 pages
Book Rating : 4.5/5 (43 download)

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Book Synopsis Partial Order in Environmental Sciences and Chemistry by : Rainer Brüggemann

Download or read book Partial Order in Environmental Sciences and Chemistry written by Rainer Brüggemann and published by Springer Science & Business Media. This book was released on 2006-08-31 with total page 404 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book explains the theory and practice of order relations in such a way that no specific mathematical skill is needed to understand the advantages of this algebraization. It acts as a primer in a mathematical technique which is useful in many expanding disciplines, like genomics, techniques of decision support, and sustainability. This book is recommended to those who are interested in the interface between sciences and management.

Solved and Unsolved Problems of Structural Chemistry

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Publisher : CRC Press
ISBN 13 : 1498711529
Total Pages : 482 pages
Book Rating : 4.4/5 (987 download)

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Book Synopsis Solved and Unsolved Problems of Structural Chemistry by : Milan Randic

Download or read book Solved and Unsolved Problems of Structural Chemistry written by Milan Randic and published by CRC Press. This book was released on 2016-04-21 with total page 482 pages. Available in PDF, EPUB and Kindle. Book excerpt: Solved and Unsolved Problems of Structural Chemistry introduces new methods and approaches for solving problems related to molecular structure. It includes numerous subjects such as aromaticity-one of the central themes of chemistry-and topics from bioinformatics such as graphical and numerical characterization of DNA, proteins, and proteomes. It a